Vitas-M small molecule compound
2-amino-3-(1,3-benzothiazol-2-yl)-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-4-oxo-4H-chromen-7-olate
Catalog ID
STL514215
SMILES CN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(N)c(c2=O)c1nc2c(s1)cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H22N4O3S MW 422.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O3S/c1-25-8-10-26(11-9-25)12-14-16(27)7-6-13-19(28)18(21(23)29-20(13)14)22-24-15-4-2-3-5-17(15)30-22/h2-7,27H,8-12,23H2,1H3InChIKey
TYDMLNCOIUYTPA-UHFFFAOYSA-NSynonyms
384360-83-22amino3(13benzothiazol2yl)8((4methylpiperazin1ium1yl)methyl)4oxo4Hchromen7olate
2AMINO3(13BENZOTHIAZOL2YL)8((4METHYLPIPERAZIN1IUM1YL)METHYL)4OXOCHROMEN7OLATE
3641277
384360832
InChI=1SC22H22N4O3Sc12581026(11925)121416(27)761319(28)18(21(23)2920(13)14)222415423517(15)3022h2727H81223H21H3
MFCD03265904
ZINC000019681964
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